Geometry & MOs

Info

ID:	365676
PubChem CID:	127318397
Reduced:	O4N5C15H15 (1)
Stoich.:	A4B5C15D15 (1)
Weight, g/mol:	252.147393
ΔH_f, kcal/mol:	-76.71
Dipole, Da:	4.01
IP(EA), eV:	-9.97(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(oxan-4-yl)-5-[2-(oxolan-2-yl)ethyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=N2)C3=NC(=NO3)C4CCOCC4)C(=O)NC1=O

DOS

IR

Vibrations